Cas no 5433-62-5 (Benzenesulfonamide,4-amino-N-(4,5-dihydro-4-methyl-5-phenyl-2-thiazolyl)-)
5433-62-5 structure
Product Name:Benzenesulfonamide,4-amino-N-(4,5-dihydro-4-methyl-5-phenyl-2-thiazolyl)-
CAS No:5433-62-5
MF:C16H17N3O2S2
MW:347.455080747604
CID:384420
PubChem ID:223625
Update Time:2025-04-19
Benzenesulfonamide,4-amino-N-(4,5-dihydro-4-methyl-5-phenyl-2-thiazolyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide,4-amino-N-(4,5-dihydro-4-methyl-5-phenyl-2-thiazolyl)-
- DTXSID00969406
- 4-amino-n-(4-methyl-5-phenyl-4,5-dihydro-1,3-thiazol-2-yl)benzenesulfonamide
- 4-Amino-N-(4-methyl-5-phenyl-4,5-dihydro-1,3-thiazol-2-yl)benzene-1-sulfonamide
- NSC11389
- 5433-62-5
- NSC-11389
-
- Inchi： 1S/C16H17N3O2S2/c1-11-15(12-5-3-2-4-6-12)22-16(18-11)19-23(20,21)14-9-7-13(17)8-10-14/h2-11,15H,17H2,1H3,(H,18,19)
- InChI Key： LGPPQORKUPUXMF-UHFFFAOYSA-N
- SMILES： S1C(NS(C2C=CC(=CC=2)N)(=O)=O)=NC(C)C1C1C=CC=CC=1
Computed Properties
- Exact Mass: 347.07641
- Monoisotopic Mass: 347.07621914g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 530
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.5
- Topological Polar Surface Area: 118?2
Experimental Properties
- PSA: 84.55
- LogP: 4.26820
Benzenesulfonamide,4-amino-N-(4,5-dihydro-4-methyl-5-phenyl-2-thiazolyl)- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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